CID 68531830

[4-(fluoromethyl)phenyl]methanol

Structural Information

Molecular Formula
C8H9FO
SMILES
C1=CC(=CC=C1CO)CF
InChI
InChI=1S/C8H9FO/c9-5-7-1-3-8(6-10)4-2-7/h1-4,10H,5-6H2
InChIKey
OQZWZXQGEIGPBK-UHFFFAOYSA-N
Compound name
[4-(fluoromethyl)phenyl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

26
Patents

140.06374 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 141.071016 125.0
[M+Na]+ 163.052958 133.4
[M-H]- 139.056464 126.3
[M+NH4]+ 158.097563 146.2
[M+K]+ 179.026898 131.0
[M+H-H2O]+ 123.061000 119.2
[M+HCOO]- 185.061941 147.6
[M+CH3COO]- 199.077591 171.5
[M+Na-2H]- 161.038406 132.1
[M]+ 140.06319142 123.3
[M]- 140.06428858 123.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe